[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone Formula: C23H23N3OS2 MolecularWeight: 421.57822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)N5C=CC=C5)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)N5C=CC=C5)C

InChI

InChI=1S/C23H23N3OS2/c1-15-16(2)28-23(26-11-5-6-12-26)20(15)22(27)25-13-9-17(10-14-25)21-24-18-7-3-4-8-19(18)29-21/h3-8,11-12,17H,9-10,13-14H2,1-2H3