1-cyclohexyl-3-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]thiourea

Systemtic Name: 1-cyclohexyl-3-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]thiourea Openeye Name: 1-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-cyclohexyl-thiourea CAS Name: 1-[[4-anilino-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-3-cyclohexylthiourea IUPAC Name: 1-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-cyclohexylthiourea Traditional Name: 1-[(4-anilino-6-pyrrolidino-s-triazin-2-yl)amino]-3-cyclohexyl-thiourea Formula: C20H28N8S MolecularWeight: 412.55492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

C1CCC(CC1)NC(=S)NNC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C20H28N8S/c29-20(22-16-11-5-2-6-12-16)27-26-18-23-17(21-15-9-3-1-4-10-15)24-19(25-18)28-13-7-8-14-28/h1,3-4,9-10,16H,2,5-8,11-14H2,(H2,22,27,29)(H2,21,23,24,25,26)