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

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-cyclopropyl-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-cyclopropyl-1-(2-furylmethyl)thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-cyclopropyl-1-(2-furanylmethyl)thiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-cyclopropyl-1-(furan-2-ylmethyl)thiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-cyclopropyl-1-(2-furfuryl)thiourea Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N(CC2=CC=CO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

Isomeric SMILES

C1CC1NC(=S)N(CC2=CC=CO2)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

InChI

InChI=1S/C20H21N5O3S/c21-17-16(18(26)23-19(27)25(17)11-13-5-2-1-3-6-13)24(12-15-7-4-10-28-15)20(29)22-14-8-9-14/h1-7,10,14H,8-9,11-12,21H2,(H,22,29)(H,23,26,27)