1-prop-2-enyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea

Systemtic Name: 1-prop-2-enyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea Openeye Name: 1-allyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea CAS Name: 1-prop-2-enyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-prop-2-enyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea Traditional Name: 1-allyl-3-[(E)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethylideneamino]thiourea Formula: C14H16N6S MolecularWeight: 300.38204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC=C)C1=CC=C(C=C1)N2C=NC=N2

Isomeric SMILES

C/C(=N\NC(=S)NCC=C)/C1=CC=C(C=C1)N2C=NC=N2

InChI

InChI=1S/C14H16N6S/c1-3-8-16-14(21)19-18-11(2)12-4-6-13(7-5-12)20-10-15-9-17-20/h3-7,9-10H,1,8H2,2H3,(H2,16,19,21)/b18-11+