N-[(Z)-3-(2-carbamothioylhydrazinyl)-1-(4-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-(2-carbamothioylhydrazinyl)-1-(4-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[(carbamothioylamino)carbamoyl]-2-(4-nitrophenyl)vinyl]benzamide CAS Name: N-[(Z)-3-(carbamothioylhydrazo)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-(2-carbamothioylhydrazinyl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-2-(4-nitrophenyl)-1-(thioureidocarbamoyl)vinyl]benzamide Formula: C17H15N5O4S MolecularWeight: 385.3971

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NNC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)NNC(=S)N

InChI

InChI=1S/C17H15N5O4S/c18-17(27)21-20-16(24)14(19-15(23)12-4-2-1-3-5-12)10-11-6-8-13(9-7-11)22(25)26/h1-10H,(H,19,23)(H,20,24)(H3,18,21,27)/b14-10-