1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea

Systemtic Name: 1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea Openeye Name: 1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea CAS Name: 1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea IUPAC Name: 1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea Traditional Name: 1,1-dicyclohexyl-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]thiourea Formula: C28H37N3O2S2 MolecularWeight: 511.74228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H37N3O2S2/c32-35(33,30-20-19-22-9-7-8-10-23(22)21-30)27-17-15-24(16-18-27)29-28(34)31(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h7-10,15-18,25-26H,1-6,11-14,19-21H2,(H,29,34)