[1-[(7-methoxy-4,5-dihydrobenzo[g][1]benzothiol-2-yl)carbonyl]piperidin-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(7-methoxy-4,5-dihydrobenzo[g][1]benzothiol-2-yl)carbonyl]piperidin-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-(7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)-4-piperidyl]-(1-piperidyl)methanone CAS Name: [1-[(7-methoxy-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-oxomethyl]-4-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: [1-(7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)piperidin-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)-4-piperidyl]-piperidino-methanone Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)N4CCC(CC4)C(=O)N5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)N4CCC(CC4)C(=O)N5CCCCC5

InChI

InChI=1S/C25H30N2O3S/c1-30-20-7-8-21-18(15-20)5-6-19-16-22(31-23(19)21)25(29)27-13-9-17(10-14-27)24(28)26-11-3-2-4-12-26/h7-8,15-17H,2-6,9-14H2,1H3