4-methyl-3-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[3-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[3-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[3-(2-pyrrolidinothiazol-4-yl)phenyl]benzamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O3S/c1-14-7-8-16(12-19(14)25(27)28)20(26)22-17-6-4-5-15(11-17)18-13-29-21(23-18)24-9-2-3-10-24/h4-8,11-13H,2-3,9-10H2,1H3,(H,22,26)