N-[1-[bis(azanyl)methylideneamino]pyrrolidin-2-yl]carbonyl-N-phenyl-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[1-[bis(azanyl)methylideneamino]pyrrolidin-2-yl]carbonyl-N-phenyl-1,3-benzothiazole-2-carboxamide Openeye Name: N-(1-guanidinopyrrolidine-2-carbonyl)-N-phenyl-1,3-benzothiazole-2-carboxamide CAS Name: N-[[1-(diaminomethylideneamino)-2-pyrrolidinyl]-oxomethyl]-N-phenyl-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[1-(diaminomethylideneamino)pyrrolidine-2-carbonyl]-N-phenyl-1,3-benzothiazole-2-carboxamide Traditional Name: N-(1-guanidinoprolyl)-N-phenyl-1,3-benzothiazole-2-carboxamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)N=C(N)N)C(=O)N(C2=CC=CC=C2)C(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)N=C(N)N)C(=O)N(C2=CC=CC=C2)C(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N6O2S/c21-20(22)24-25-12-6-10-15(25)18(27)26(13-7-2-1-3-8-13)19(28)17-23-14-9-4-5-11-16(14)29-17/h1-5,7-9,11,15H,6,10,12H2,(H4,21,22,24)