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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H21N5O3S/c1-24(20(29)22-14-9-6-10-15(11-14)28-2)16-17(21)25(19(27)23-18(16)26)12-13-7-4-3-5-8-13/h3-11H,12,21H2,1-2H3,(H,22,29)(H,23,26,27)