N-[azanyl-[[3-(phenylsulfonyl)pyrrolidin-1-yl]amino]methylidene]benzamide hydrochloride

Systemtic Name: N-[azanyl-[[3-(phenylsulfonyl)pyrrolidin-1-yl]amino]methylidene]benzamide hydrochloride Openeye Name: N-[amino-[[3-(benzenesulfonyl)pyrrolidin-1-yl]amino]methylene]benzamide hydrochloride CAS Name: N-[amino-[[3-(benzenesulfonyl)-1-pyrrolidinyl]amino]methylidene]benzamide hydrochloride IUPAC Name: N-[amino-[[3-(benzenesulfonyl)pyrrolidin-1-yl]amino]methylidene]benzamide hydrochloride Traditional Name: N-[amino-[(3-besylpyrrolidino)amino]methylene]benzamide hydrochloride Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1S(=O)(=O)C2=CC=CC=C2)NC(=NC(=O)C3=CC=CC=C3)N.Cl

Isomeric SMILES

C1CN(CC1S(=O)(=O)C2=CC=CC=C2)NC(=NC(=O)C3=CC=CC=C3)N.Cl

InChI

InChI=1S/C18H20N4O3S.ClH/c19-18(20-17(23)14-7-3-1-4-8-14)21-22-12-11-16(13-22)26(24,25)15-9-5-2-6-10-15;/h1-10,16H,11-13H2,(H3,19,20,21,23);1H