N-[3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-chloranyl-benzamide

Systemtic Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-chloranyl-benzamide Openeye Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-oxo-propyl]-4-chloro-benzamide CAS Name: N-[3-[4-(1-azepanylsulfonyl)-1-piperazinyl]-3-oxopropyl]-4-chlorobenzamide IUPAC Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-oxopropyl]-4-chlorobenzamide Traditional Name: N-[3-[4-(azepan-1-ylsulfonyl)piperazino]-3-keto-propyl]-4-chloro-benzamide Formula: C20H29ClN4O4S MolecularWeight: 456.98666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H29ClN4O4S/c21-18-7-5-17(6-8-18)20(27)22-10-9-19(26)23-13-15-25(16-14-23)30(28,29)24-11-3-1-2-4-12-24/h5-8H,1-4,9-16H2,(H,22,27)