S-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamoylamino] thiophene-2-carbothioate

Systemtic Name: S-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamoylamino] thiophene-2-carbothioate Openeye Name: S-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamoylamino] thiophene-2-carbothioate CAS Name: 2-thiophenecarbothioic acid S-[[[[2-(4-methoxyphenyl)-5-benzotriazolyl]amino]-oxomethyl]amino] ester IUPAC Name: S-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamoylamino] thiophene-2-carbothioate Traditional Name: thiophene-2-carbothioic acid S-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamoylamino] ester Formula: C19H15N5O3S2 MolecularWeight: 425.4841

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)NSC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)NSC(=O)C4=CC=CS4

InChI

InChI=1S/C19H15N5O3S2/c1-27-14-7-5-13(6-8-14)24-21-15-9-4-12(11-16(15)22-24)20-19(26)23-29-18(25)17-3-2-10-28-17/h2-11H,1H3,(H2,20,23,26)