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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-butyl-3-(4-methoxyphenyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-butyl-3-(4-methoxyphenyl)thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-butyl-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-butyl-3-(4-methoxyphenyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-butyl-3-(4-methoxyphenyl)thiourea Formula: C20H29N5O3S MolecularWeight: 419.54096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=S)NC2=CC=C(C=C2)OC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=S)NC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C20H29N5O3S/c1-4-6-12-24(20(29)22-14-8-10-15(28-3)11-9-14)16-17(21)25(13-7-5-2)19(27)23-18(16)26/h8-11H,4-7,12-13,21H2,1-3H3,(H,22,29)(H,23,26,27)