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

Systemtic Name: N-[2-(furan-2-yl)ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-[2-(2-furyl)ethyl]-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-[2-(2-furanyl)ethyl]-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-[2-(furan-2-yl)ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-[2-(2-furyl)ethyl]-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C17H15N3O4S2 MolecularWeight: 389.4487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NCCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NCCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4S2/c1-11-10-25-17(19-11)26-15-5-4-12(9-14(15)20(22)23)16(21)18-7-6-13-3-2-8-24-13/h2-5,8-10H,6-7H2,1H3,(H,18,21)