4-(1,3-benzothiazol-2-yl)-N-[2-[(4-nitrophenyl)amino]ethyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2-[(4-nitrophenyl)amino]ethyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-nitroanilino)ethyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-nitroanilino)ethyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-nitroanilino)ethyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-nitroanilino)ethyl]butyramide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O3S/c24-18(6-3-7-19-22-16-4-1-2-5-17(16)27-19)21-13-12-20-14-8-10-15(11-9-14)23(25)26/h1-2,4-5,8-11,20H,3,6-7,12-13H2,(H,21,24)