N-[bis(azanyl)methylidene]-3-(4-methylpiperazin-1-yl)carbonyl-5-pyrrol-1-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-3-(4-methylpiperazin-1-yl)carbonyl-5-pyrrol-1-yl-benzamide Openeye Name: N-(diaminomethylene)-3-(4-methylpiperazine-1-carbonyl)-5-pyrrol-1-yl-benzamide CAS Name: N-(diaminomethylidene)-3-[(4-methyl-1-piperazinyl)-oxomethyl]-5-(1-pyrrolyl)benzamide IUPAC Name: N-(diaminomethylidene)-3-(4-methylpiperazine-1-carbonyl)-5-pyrrol-1-ylbenzamide Traditional Name: N-(diaminomethylene)-3-(4-methylpiperazine-1-carbonyl)-5-pyrrol-1-yl-benzamide Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC(=CC(=C2)C(=O)N=C(N)N)N3C=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC(=CC(=C2)C(=O)N=C(N)N)N3C=CC=C3

InChI

InChI=1S/C18H22N6O2/c1-22-6-8-24(9-7-22)17(26)14-10-13(16(25)21-18(19)20)11-15(12-14)23-4-2-3-5-23/h2-5,10-12H,6-9H2,1H3,(H4,19,20,21,25)