(1-naphthalen-1-ylcarbonylpiperidin-3-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (1-naphthalen-1-ylcarbonylpiperidin-3-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: [1-(naphthalene-1-carbonyl)-3-piperidyl]-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: [1-[1-naphthalenyl(oxo)methyl]-3-piperidinyl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: [1-(naphthalene-1-carbonyl)piperidin-3-yl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: [1-(1-naphthoyl)-3-piperidyl]-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)N4CCCN(CC4)CC5=CC=CS5

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)N4CCCN(CC4)CC5=CC=CS5

InChI

InChI=1S/C27H31N3O2S/c31-26(29-15-6-13-28(16-17-29)20-23-10-5-18-33-23)22-9-4-14-30(19-22)27(32)25-12-3-8-21-7-1-2-11-24(21)25/h1-3,5,7-8,10-12,18,22H,4,6,9,13-17,19-20H2