1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-ethyl-3-(2-phenylsulfanylethyl)thiourea

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-ethyl-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-ethyl-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-ethyl-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-ethyl-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-ethyl-3-[2-(phenylthio)ethyl]thiourea Formula: C19H27N5O2S2 MolecularWeight: 421.57998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=S)NCCSC2=CC=CC=C2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=S)NCCSC2=CC=CC=C2)N

InChI

InChI=1S/C19H27N5O2S2/c1-3-5-12-24-16(20)15(17(25)22-18(24)26)23(4-2)19(27)21-11-13-28-14-9-7-6-8-10-14/h6-10H,3-5,11-13,20H2,1-2H3,(H,21,27)(H,22,25,26)