2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrophenyl)methyleneamino]propanamide CAS Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(E)-(4-nitrobenzylidene)amino]propionamide Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC=C(C=C1)[N+](=O)[O-])NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15N5O3S/c1-11(19-17-20-14-4-2-3-5-15(14)26-17)16(23)21-18-10-12-6-8-13(9-7-12)22(24)25/h2-11H,1H3,(H,19,20)(H,21,23)/b18-10+