[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: [1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: [1-[(5-methyl-2-thienyl)sulfonyl]-3-piperidyl]-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: [1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinyl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: [1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: [1-[(5-methyl-2-thienyl)sulfonyl]-3-piperidyl]-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C21H29N3O3S3 MolecularWeight: 467.66826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C21H29N3O3S3/c1-17-7-8-20(29-17)30(26,27)24-11-2-5-18(15-24)21(25)23-10-4-9-22(12-13-23)16-19-6-3-14-28-19/h3,6-8,14,18H,2,4-5,9-13,15-16H2,1H3