3-[(4-methylphenyl)sulfonylamino]-N-prop-2-enyl-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-N-prop-2-enyl-4-pyrrolidin-1-yl-benzamide Openeye Name: N-allyl-3-(p-tolylsulfonylamino)-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[(4-methylphenyl)sulfonylamino]-N-prop-2-enyl-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-N-prop-2-enyl-4-pyrrolidin-1-ylbenzamide Traditional Name: N-allyl-4-pyrrolidino-3-(tosylamino)benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC=C)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC=C)N3CCCC3

InChI

InChI=1S/C21H25N3O3S/c1-3-12-22-21(25)17-8-11-20(24-13-4-5-14-24)19(15-17)23-28(26,27)18-9-6-16(2)7-10-18/h3,6-11,15,23H,1,4-5,12-14H2,2H3,(H,22,25)