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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-(furan-2-ylmethyl)-1-(3-methylbutyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-(2-furylmethyl)-1-isopentyl-thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-(2-furanylmethyl)-1-(3-methylbutyl)thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-(furan-2-ylmethyl)-1-(3-methylbutyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-(2-furfuryl)-1-isoamyl-thiourea Formula: C19H29N5O3S MolecularWeight: 407.53026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=S)NCC2=CC=CO2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=S)NCC2=CC=CO2)N

InChI

InChI=1S/C19H29N5O3S/c1-4-5-9-24-16(20)15(17(25)22-18(24)26)23(10-8-13(2)3)19(28)21-12-14-7-6-11-27-14/h6-7,11,13H,4-5,8-10,12,20H2,1-3H3,(H,21,28)(H,22,25,26)