1-(4-ethoxyphenyl)-3-[[(2R)-6-methylheptan-2-yl]carbamothioylamino]thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[[(2R)-6-methylheptan-2-yl]carbamothioylamino]thiourea Openeye Name: 1-[(1R)-1,5-dimethylhexyl]-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]-3-[(2R)-6-methylheptan-2-yl]thiourea IUPAC Name: 1-(4-ethoxyphenyl)-3-[[(2R)-6-methylheptan-2-yl]carbamothioylamino]thiourea Traditional Name: 1-[(1R)-1,5-dimethylhexyl]-3-(p-phenetylthiocarbamoylamino)thiourea Formula: C18H30N4OS2 MolecularWeight: 382.587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)NC(C)CCCC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)N[C@H](C)CCCC(C)C

InChI

InChI=1S/C18H30N4OS2/c1-5-23-16-11-9-15(10-12-16)20-18(25)22-21-17(24)19-14(4)8-6-7-13(2)3/h9-14H,5-8H2,1-4H3,(H2,19,21,24)(H2,20,22,25)/t14-/m1/s1