1-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenyl-thiourea

Systemtic Name: 1-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenyl-thiourea Openeye Name: 1-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-thiourea CAS Name: 1-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenylthiourea IUPAC Name: 1-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenylthiourea Traditional Name: 1-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-thiourea Formula: C14H18N4S2 MolecularWeight: 306.44952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C14H18N4S2/c1-3-10(4-2)12-17-18-14(20-12)16-13(19)15-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3,(H2,15,16,18,19)