2-chloranyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxo-ethyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-[2-(cyclopropylamino)-2-keto-ethyl]-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C22H25ClN4O4S MolecularWeight: 476.9763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CC1NC(=O)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O4S/c23-20-9-8-18(14-19(20)22(29)24-15-21(28)25-16-6-7-16)32(30,31)27-12-10-26(11-13-27)17-4-2-1-3-5-17/h1-5,8-9,14,16H,6-7,10-13,15H2,(H,24,29)(H,25,28)