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

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-1-(3-methoxypropyl)-3-methyl-thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-1-(3-methoxypropyl)-3-methyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-1-(3-methoxypropyl)-3-methylthiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-1-(3-methoxypropyl)-3-methylthiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-1-(3-methoxypropyl)-3-methyl-thiourea Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(CCCOC)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

Isomeric SMILES

CNC(=S)N(CCCOC)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

InChI

InChI=1S/C17H23N5O3S/c1-19-17(26)21(9-6-10-25-2)13-14(18)22(16(24)20-15(13)23)11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11,18H2,1-2H3,(H,19,26)(H,20,23,24)