4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-(3-propan-2-yloxypropyl)benzamide

Systemtic Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Openeye Name: N-(3-isopropoxypropyl)-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: 4-[(4-methyl-2-thiazolyl)thio]-3-nitro-N-(3-propan-2-yloxypropyl)benzamide IUPAC Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Traditional Name: N-(3-isopropoxypropyl)-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NCCCOC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NCCCOC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S2/c1-11(2)24-8-4-7-18-16(21)13-5-6-15(14(9-13)20(22)23)26-17-19-12(3)10-25-17/h5-6,9-11H,4,7-8H2,1-3H3,(H,18,21)