1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-pyrimidin-2-yl-thiourea

Systemtic Name: 1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-pyrimidin-2-yl-thiourea Openeye Name: 1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-pyrimidin-2-yl-thiourea CAS Name: 1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-(2-pyrimidinyl)thiourea IUPAC Name: 1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-pyrimidin-2-ylthiourea Traditional Name: 1-[4-(3-propoxy-1,2,4-triazol-1-yl)phenyl]-3-(2-pyrimidyl)thiourea Formula: C16H17N7OS MolecularWeight: 355.41748

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C=N1)C2=CC=C(C=C2)NC(=S)NC3=NC=CC=N3

Isomeric SMILES

CCCOC1=NN(C=N1)C2=CC=C(C=C2)NC(=S)NC3=NC=CC=N3

InChI

InChI=1S/C16H17N7OS/c1-2-10-24-15-19-11-23(22-15)13-6-4-12(5-7-13)20-16(25)21-14-17-8-3-9-18-14/h3-9,11H,2,10H2,1H3,(H2,17,18,20,21,25)