1-(4-bromanyl-3-methyl-phenyl)-3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[[6-methyl-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]methyl]urea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea Formula: C21H23BrN4OS MolecularWeight: 459.40252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NCC2=C(SC3=C2CCN(C3)C)N4C=CC=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NCC2=C(SC3=C2CCN(C3)C)N4C=CC=C4)Br

InChI

InChI=1S/C21H23BrN4OS/c1-14-11-15(5-6-18(14)22)24-21(27)23-12-17-16-7-10-25(2)13-19(16)28-20(17)26-8-3-4-9-26/h3-6,8-9,11H,7,10,12-13H2,1-2H3,(H2,23,24,27)