1-[4-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[4-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]thiourea CAS Name: 1-[4-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]-3-prop-2-enylthiourea IUPAC Name: 1-[4-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)phenyl]thiourea Formula: C13H15N5S2 MolecularWeight: 305.4217

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)C2=CC=C(C=C2)NC(=S)NCC=C

Isomeric SMILES

CN1C(=NNC1=S)C2=CC=C(C=C2)NC(=S)NCC=C

InChI

InChI=1S/C13H15N5S2/c1-3-8-14-12(19)15-10-6-4-9(5-7-10)11-16-17-13(20)18(11)2/h3-7H,1,8H2,2H3,(H,17,20)(H2,14,15,19)