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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(3-methylbutyl)-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-isopentyl-thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-(3-methylbutyl)-3-prop-2-enylthiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-(3-methylbutyl)-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-isoamyl-thiourea Formula: C17H29N5O2S MolecularWeight: 367.50946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=S)NCC=C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=S)NCC=C)N

InChI

InChI=1S/C17H29N5O2S/c1-5-7-10-22-14(18)13(15(23)20-16(22)24)21(11-8-12(3)4)17(25)19-9-6-2/h6,12H,2,5,7-11,18H2,1,3-4H3,(H,19,25)(H,20,23,24)