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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-cyclopropyl-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-cyclopropyl-1-(2-furylmethyl)thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-cyclopropyl-1-(2-furanylmethyl)thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-cyclopropyl-1-(furan-2-ylmethyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-cyclopropyl-1-(2-furfuryl)thiourea Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=S)NC3CC3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=S)NC3CC3)N

InChI

InChI=1S/C17H23N5O3S/c1-2-3-8-21-14(18)13(15(23)20-16(21)24)22(10-12-5-4-9-25-12)17(26)19-11-6-7-11/h4-5,9,11H,2-3,6-8,10,18H2,1H3,(H,19,26)(H,20,23,24)