1-[2-methyl-4-[1-[3-methyl-4-(prop-2-enylcarbamothioylamino)phenyl]cyclohexyl]phenyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[2-methyl-4-[1-[3-methyl-4-(prop-2-enylcarbamothioylamino)phenyl]cyclohexyl]phenyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-[1-[4-(allylcarbamothioylamino)-3-methyl-phenyl]cyclohexyl]-2-methyl-phenyl]thiourea CAS Name: 1-[2-methyl-4-[1-[3-methyl-4-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]phenyl]cyclohexyl]phenyl]-3-prop-2-enylthiourea IUPAC Name: 1-[2-methyl-4-[1-[3-methyl-4-(prop-2-enylcarbamothioylamino)phenyl]cyclohexyl]phenyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-[1-[4-(allylthiocarbamoylamino)-3-methyl-phenyl]cyclohexyl]-2-methyl-phenyl]thiourea Formula: C28H36N4S2 MolecularWeight: 492.74224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)NC(=S)NCC=C)C)NC(=S)NCC=C

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)NC(=S)NCC=C)C)NC(=S)NCC=C

InChI

InChI=1S/C28H36N4S2/c1-5-16-29-26(33)31-24-12-10-22(18-20(24)3)28(14-8-7-9-15-28)23-11-13-25(21(4)19-23)32-27(34)30-17-6-2/h5-6,10-13,18-19H,1-2,7-9,14-17H2,3-4H3,(H2,29,31,33)(H2,30,32,34)