1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethyl-thiourea

Systemtic Name: 1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethyl-thiourea Openeye Name: 1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethyl-thiourea CAS Name: 1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethylthiourea IUPAC Name: 1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethylthiourea Traditional Name: 1-[4-[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenethyl-thiourea Formula: C23H27N5S2 MolecularWeight: 437.62398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NN=C(S2)C3=CC=C(C=C3)NC(=S)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC2=NN=C(S2)C3=CC=C(C=C3)NC(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C23H27N5S2/c29-22(24-16-15-17-7-3-1-4-8-17)25-20-13-11-18(12-14-20)21-27-28-23(30-21)26-19-9-5-2-6-10-19/h1,3-4,7-8,11-14,19H,2,5-6,9-10,15-16H2,(H,26,28)(H2,24,25,29)