1-[(4-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]urea

Systemtic Name: 1-[(4-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]urea Openeye Name: 1-[(4-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)thiazol-2-yl]urea CAS Name: 1-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-3-[4-(4-nitrophenyl)-2-thiazolyl]urea IUPAC Name: 1-[(4-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]urea Traditional Name: 1-[(4-methoxyphenyl)thiocarbamoylamino]-3-[4-(4-nitrophenyl)thiazol-2-yl]urea Formula: C18H16N6O4S2 MolecularWeight: 444.48744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O4S2/c1-28-14-8-4-12(5-9-14)19-17(29)23-22-16(25)21-18-20-15(10-30-18)11-2-6-13(7-3-11)24(26)27/h2-10H,1H3,(H2,19,23,29)(H2,20,21,22,25)