cyclopropyl-[4-[(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperazin-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperazin-1-yl]methanone Openeye Name: cyclopropyl-[4-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazin-1-yl]methanone CAS Name: cyclopropyl-[4-[oxo-[2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl]-1-piperazinyl]methanone IUPAC Name: cyclopropyl-[4-(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperazin-1-yl]methanone Traditional Name: cyclopropyl-[4-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazino]methanone Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C(=O)C5CC5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCN(CC4)C(=O)C5CC5

InChI

InChI=1S/C21H25N3O2S/c25-19(15-7-8-15)22-11-13-23(14-12-22)20(26)18-16-5-1-2-6-17(16)27-21(18)24-9-3-4-10-24/h3-4,9-10,15H,1-2,5-8,11-14H2