2-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 2-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazino]acetyl]amino]-N-cyclopropyl-benzamide Formula: C22H33N5O4S MolecularWeight: 463.59352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C22H33N5O4S/c28-21(24-20-8-4-3-7-19(20)22(29)23-18-9-10-18)17-25-13-15-27(16-14-25)32(30,31)26-11-5-1-2-6-12-26/h3-4,7-8,18H,1-2,5-6,9-17H2,(H,23,29)(H,24,28)