1-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-(p-tolyl)thiourea CAS Name: 1-[[4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[(4,6-dipyrrolidino-s-triazin-2-yl)amino]-3-(p-tolyl)thiourea Formula: C19H26N8S MolecularWeight: 398.52834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4

InChI

InChI=1S/C19H26N8S/c1-14-6-8-15(9-7-14)20-19(28)25-24-16-21-17(26-10-2-3-11-26)23-18(22-16)27-12-4-5-13-27/h6-9H,2-5,10-13H2,1H3,(H2,20,25,28)(H,21,22,23,24)