[4-[2-(2,5-dimethylpyrrol-1-yl)thiophen-3-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2-(2,5-dimethylpyrrol-1-yl)thiophen-3-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[2-(2,5-dimethyl-1-pyrrolyl)-3-thiophenyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]piperazino]-phenyl-methanone Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CS2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CS2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H23N3O2S/c1-16-8-9-17(2)25(16)22-19(10-15-28-22)21(27)24-13-11-23(12-14-24)20(26)18-6-4-3-5-7-18/h3-10,15H,11-14H2,1-2H3