N-[4-[2-(3-methoxyphenyl)ethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-[2-(3-methoxyphenyl)ethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-[2-(3-methoxyphenyl)ethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide CAS Name: N-[4-[[[2-(3-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-[2-(3-methoxyphenyl)ethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide Traditional Name: N-[4-[2-(3-methoxyphenyl)ethylthiocarbamoylamino]phenyl]thiadiazole-4-carboxamide Formula: C19H19N5O2S2 MolecularWeight: 413.51646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3

Isomeric SMILES

COC1=CC=CC(=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3

InChI

InChI=1S/C19H19N5O2S2/c1-26-16-4-2-3-13(11-16)9-10-20-19(27)22-15-7-5-14(6-8-15)21-18(25)17-12-28-24-23-17/h2-8,11-12H,9-10H2,1H3,(H,21,25)(H2,20,22,27)