1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-(4-morpholin-4-ylcarbonylpiperazin-1-yl)ethanoyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methyl-propan-1-one

Systemtic Name: 1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-(4-morpholin-4-ylcarbonylpiperazin-1-yl)ethanoyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methyl-propan-1-one Openeye Name: 1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-[4-(morpholine-4-carbonyl)piperazin-1-yl]acetyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methyl-propan-1-one CAS Name: 1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-[4-[4-morpholinyl(oxo)methyl]-1-piperazinyl]-1-oxoethyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methyl-1-propanone IUPAC Name: 1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-[4-(morpholine-4-carbonyl)piperazin-1-yl]acetyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methylpropan-1-one Traditional Name: 1-(1-azabicyclo[2.2.1]heptan-7-yl)-2-[5-(3,5-dimethylphenyl)-4-[2-[4-(morpholine-4-carbonyl)piperazino]acetyl]-6H-thieno[2,3-b]pyrrol-2-yl]-2-methyl-propan-1-one Formula: C35H45N5O4S MolecularWeight: 631.8279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)SC(=C3)C(C)(C)C(=O)C4C5CCN4CC5)C(=O)CN6CCN(CC6)C(=O)N7CCOCC7)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)SC(=C3)C(C)(C)C(=O)C4C5CCN4CC5)C(=O)CN6CCN(CC6)C(=O)N7CCOCC7)C

InChI

InChI=1S/C35H45N5O4S/c1-22-17-23(2)19-25(18-22)30-29(27(41)21-37-9-11-39(12-10-37)34(43)40-13-15-44-16-14-40)26-20-28(45-33(26)36-30)35(3,4)32(42)31-24-5-7-38(31)8-6-24/h17-20,24,31,36H,5-16,21H2,1-4H3