4-[2,5-dimethyl-1-(phenylmethyl)indol-3-yl]-N-(3-methylcyclohexyl)-1,3-thiazol-2-amine

Systemtic Name: 4-[2,5-dimethyl-1-(phenylmethyl)indol-3-yl]-N-(3-methylcyclohexyl)-1,3-thiazol-2-amine Openeye Name: 4-(1-benzyl-2,5-dimethyl-indol-3-yl)-N-(3-methylcyclohexyl)thiazol-2-amine CAS Name: 4-[2,5-dimethyl-1-(phenylmethyl)-3-indolyl]-N-(3-methylcyclohexyl)-2-thiazolamine IUPAC Name: 4-(1-benzyl-2,5-dimethylindol-3-yl)-N-(3-methylcyclohexyl)-1,3-thiazol-2-amine Traditional Name: [4-(1-benzyl-2,5-dimethyl-indol-3-yl)thiazol-2-yl]-(3-methylcyclohexyl)amine Formula: C27H31N3S MolecularWeight: 429.62014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NC2=NC(=CS2)C3=C(N(C4=C3C=C(C=C4)C)CC5=CC=CC=C5)C

Isomeric SMILES

CC1CCCC(C1)NC2=NC(=CS2)C3=C(N(C4=C3C=C(C=C4)C)CC5=CC=CC=C5)C

InChI

InChI=1S/C27H31N3S/c1-18-8-7-11-22(14-18)28-27-29-24(17-31-27)26-20(3)30(16-21-9-5-4-6-10-21)25-13-12-19(2)15-23(25)26/h4-6,9-10,12-13,15,17-18,22H,7-8,11,14,16H2,1-3H3,(H,28,29)