2-(4-methyl-1,3-thiazol-2-yl)-1-[4-(3-pyrrol-1-ylphenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-1-[4-(3-pyrrol-1-ylphenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-methylthiazol-2-yl)-1-[4-(3-pyrrol-1-ylbenzoyl)piperazin-1-yl]ethanone CAS Name: 2-(4-methyl-2-thiazolyl)-1-[4-[oxo-[3-(1-pyrrolyl)phenyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-1-[4-(3-pyrrol-1-ylbenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-methylthiazol-2-yl)-1-[4-(3-pyrrol-1-ylbenzoyl)piperazino]ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)CC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

CC1=CSC(=N1)CC(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C21H22N4O2S/c1-16-15-28-19(22-16)14-20(26)24-9-11-25(12-10-24)21(27)17-5-4-6-18(13-17)23-7-2-3-8-23/h2-8,13,15H,9-12,14H2,1H3