1-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-benzyl-3-[[(E)-3-(3-nitrophenyl)acryloyl]amino]thiourea Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O3S/c22-16(10-9-13-7-4-8-15(11-13)21(23)24)19-20-17(25)18-12-14-5-2-1-3-6-14/h1-11H,12H2,(H,19,22)(H2,18,20,25)/b10-9+