1-(4-methoxyphenyl)-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]cyclopropane-1-carboxamide Openeye Name: 1-(4-methoxyphenyl)-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]cyclopropanecarboxamide CAS Name: 1-(4-methoxyphenyl)-N-[4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1,4-diazepan-1-yl]methyl]-4-piperidinyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-methoxyphenyl)-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]piperidin-4-yl]cyclopropane-1-carboxamide Traditional Name: 1-(4-methoxyphenyl)-N-[4-[4-(2-thenoyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]cyclopropanecarboxamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC2)C(=O)NC3(CCNCC3)C(=O)N4CCCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC2)C(=O)NC3(CCNCC3)C(=O)N4CCCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H34N4O4S/c1-35-21-7-5-20(6-8-21)26(9-10-26)24(33)29-27(11-13-28-14-12-27)25(34)31-16-3-15-30(17-18-31)23(32)22-4-2-19-36-22/h2,4-8,19,28H,3,9-18H2,1H3,(H,29,33)