1-[3-azanyl-4-(1H-indol-3-yl)-6-methyl-2-(4-methylphenyl)carbonyl-thieno[2,3-b]pyridin-5-yl]ethanone

Systemtic Name: 1-[3-azanyl-4-(1H-indol-3-yl)-6-methyl-2-(4-methylphenyl)carbonyl-thieno[2,3-b]pyridin-5-yl]ethanone Openeye Name: 1-[3-amino-4-(1H-indol-3-yl)-6-methyl-2-(4-methylbenzoyl)thieno[2,3-b]pyridin-5-yl]ethanone CAS Name: 1-[3-amino-4-(1H-indol-3-yl)-6-methyl-2-[(4-methylphenyl)-oxomethyl]-5-thieno[2,3-b]pyridinyl]ethanone IUPAC Name: 1-[3-amino-4-(1H-indol-3-yl)-6-methyl-2-(4-methylbenzoyl)thieno[2,3-b]pyridin-5-yl]ethanone Traditional Name: 1-[3-amino-4-(1H-indol-3-yl)-6-methyl-2-p-toluoyl-thieno[2,3-b]pyridin-5-yl]ethanone Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C3=C(C(=C(N=C3S2)C)C(=O)C)C4=CNC5=CC=CC=C54)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C3=C(C(=C(N=C3S2)C)C(=O)C)C4=CNC5=CC=CC=C54)N

InChI

InChI=1S/C26H21N3O2S/c1-13-8-10-16(11-9-13)24(31)25-23(27)22-21(18-12-28-19-7-5-4-6-17(18)19)20(15(3)30)14(2)29-26(22)32-25/h4-12,28H,27H2,1-3H3