(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: [4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)-(4-phenylpiperazino)methanone Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=C4)N5C=CC=C5)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=C4)N5C=CC=C5)C

InChI

InChI=1S/C24H24N4OS/c1-17-16-18(2)25-23-20(17)21(27-10-6-7-11-27)22(30-23)24(29)28-14-12-26(13-15-28)19-8-4-3-5-9-19/h3-11,16H,12-15H2,1-2H3