3-[4-(3-azanyl-4-chloranyl-phenyl)sulfonylpiperazin-1-yl]carbonylbenzenecarboximidamide

Systemtic Name: 3-[4-(3-azanyl-4-chloranyl-phenyl)sulfonylpiperazin-1-yl]carbonylbenzenecarboximidamide Openeye Name: 3-[4-(3-amino-4-chloro-phenyl)sulfonylpiperazine-1-carbonyl]benzamidine CAS Name: 3-[[4-(3-amino-4-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]benzenecarboximidamide IUPAC Name: 3-[4-(3-amino-4-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzenecarboximidamide Traditional Name: 3-[4-(3-amino-4-chloro-phenyl)sulfonylpiperazine-1-carbonyl]benzamidine Formula: C18H20ClN5O3S MolecularWeight: 421.9011

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC(=C2)C(=N)N)S(=O)(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC(=C2)C(=N)N)S(=O)(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C18H20ClN5O3S/c19-15-5-4-14(11-16(15)20)28(26,27)24-8-6-23(7-9-24)18(25)13-3-1-2-12(10-13)17(21)22/h1-5,10-11H,6-9,20H2,(H3,21,22)