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

Systemtic Name: 1-[(2-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]urea Openeye Name: 1-[(2-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)thiazol-2-yl]urea CAS Name: 1-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]-3-[4-(4-nitrophenyl)-2-thiazolyl]urea IUPAC Name: 1-[(2-methoxyphenyl)carbamothioylamino]-3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]urea Traditional Name: 1-[(2-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=CC=C1NC(=S)NNC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NNC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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