N-[bis(azanyl)methylidene]-4-chloranyl-2-methyl-5-methylsulfonyl-3,6-di(pyrrol-1-yl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-chloranyl-2-methyl-5-methylsulfonyl-3,6-di(pyrrol-1-yl)benzamide Openeye Name: 4-chloro-N-(diaminomethylene)-2-methyl-5-methylsulfonyl-3,6-di(pyrrol-1-yl)benzamide CAS Name: 4-chloro-N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-3,6-bis(1-pyrrolyl)benzamide IUPAC Name: 4-chloro-N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-3,6-di(pyrrol-1-yl)benzamide Traditional Name: 4-chloro-N-(diaminomethylene)-5-mesyl-2-methyl-3,6-di(pyrrol-1-yl)benzamide Formula: C18H18ClN5O3S MolecularWeight: 419.88522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1N2C=CC=C2)Cl)S(=O)(=O)C)N3C=CC=C3)C(=O)N=C(N)N

Isomeric SMILES

CC1=C(C(=C(C(=C1N2C=CC=C2)Cl)S(=O)(=O)C)N3C=CC=C3)C(=O)N=C(N)N

InChI

InChI=1S/C18H18ClN5O3S/c1-11-12(17(25)22-18(20)21)15(24-9-5-6-10-24)16(28(2,26)27)13(19)14(11)23-7-3-4-8-23/h3-10H,1-2H3,(H4,20,21,22,25)