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

Systemtic Name: 2-chloranyl-4-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[3-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]benzamide CAS Name: 2-chloro-4-nitro-N-[3-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[3-(2-pyrrolidinothiazol-4-yl)phenyl]benzamide Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H17ClN4O3S/c21-17-11-15(25(27)28)6-7-16(17)19(26)22-14-5-3-4-13(10-14)18-12-29-20(23-18)24-8-1-2-9-24/h3-7,10-12H,1-2,8-9H2,(H,22,26)