N-(3,4-dihydro-2H-thiochromen-4-yl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: 3-(2-nitroanilino)-N-thiochroman-4-yl-propanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(2-nitroanilino)propanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(2-nitroanilino)propanamide Traditional Name: 3-(2-nitroanilino)-N-thiochroman-4-yl-propionamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c22-18(9-11-19-15-6-2-3-7-16(15)21(23)24)20-14-10-12-25-17-8-4-1-5-13(14)17/h1-8,14,19H,9-12H2,(H,20,22)