N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-propan-2-ylsulfanyl-benzamide Openeye Name: 4-isopropylsulfanyl-N-[4-(4-nitrophenyl)thiazol-2-yl]benzamide CAS Name: N-[4-(4-nitrophenyl)-2-thiazolyl]-4-(propan-2-ylthio)benzamide IUPAC Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-propan-2-ylsulfanylbenzamide Traditional Name: 4-(isopropylthio)-N-[4-(4-nitrophenyl)thiazol-2-yl]benzamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O3S2/c1-12(2)27-16-9-5-14(6-10-16)18(23)21-19-20-17(11-26-19)13-3-7-15(8-4-13)22(24)25/h3-12H,1-2H3,(H,20,21,23)