N-(3-nitrophenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(3-nitrophenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-(3-nitrophenyl)-3-(2-thioxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-(3-nitrophenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-(3-nitrophenyl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(3-nitrophenyl)-3-(2-thioxo-1,3-benzoxazol-3-yl)propionamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)O2)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)O2)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-15(17-11-4-3-5-12(10-11)19(21)22)8-9-18-13-6-1-2-7-14(13)23-16(18)24/h1-7,10H,8-9H2,(H,17,20)