1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(4-ethoxyphenyl)thiourea

Systemtic Name: 1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-p-phenetyl-thiourea Formula: C17H18N6O2S MolecularWeight: 370.42882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H18N6O2S/c1-2-25-13-9-7-12(8-10-13)18-17(26)21-20-16(24)11-23-15-6-4-3-5-14(15)19-22-23/h3-10H,2,11H2,1H3,(H,20,24)(H2,18,21,26)