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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=N2)NNC(=S)NCC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=N2)NNC(=S)NCC3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C19H26N8S/c28-19(20-14-15-8-2-1-3-9-15)25-24-16-21-17(26-10-4-5-11-26)23-18(22-16)27-12-6-7-13-27/h1-3,8-9H,4-7,10-14H2,(H2,20,25,28)(H,21,22,23,24)