(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-(4-phenylpiperazin-1-yl)methanone CAS Name: [4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-(4-phenylpiperazino)methanone Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C21H23N3OS/c1-16-17(2)26-21(24-10-6-7-11-24)19(16)20(25)23-14-12-22(13-15-23)18-8-4-3-5-9-18/h3-11H,12-15H2,1-2H3