1-[2-[(3-methoxyphenyl)amino]ethanoylamino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[2-[(3-methoxyphenyl)amino]ethanoylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[[2-(3-methoxyanilino)acetyl]amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[2-(3-methoxyanilino)-1-oxoethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[[2-(3-methoxyanilino)acetyl]amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[[2-(m-anisidino)acetyl]amino]-3-(4-nitrophenyl)thiourea Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NCC(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NCC(=O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O4S/c1-25-14-4-2-3-12(9-14)17-10-15(22)19-20-16(26)18-11-5-7-13(8-6-11)21(23)24/h2-9,17H,10H2,1H3,(H,19,22)(H2,18,20,26)