N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-(2-nitroanilino)propanamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-(2-nitroanilino)propanamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-(2-nitroanilino)propionamide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4S/c1-13(26)22-15-8-6-14(7-9-15)17-12-30-20(23-17)24-19(27)10-11-21-16-4-2-3-5-18(16)25(28)29/h2-9,12,21H,10-11H2,1H3,(H,22,26)(H,23,24,27)