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

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-1-(3-methoxypropyl)-3-propyl-thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-1-(3-methoxypropyl)-3-propyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-1-(3-methoxypropyl)-3-propylthiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-1-(3-methoxypropyl)-3-propylthiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-1-(3-methoxypropyl)-3-propyl-thiourea Formula: C19H27N5O3S MolecularWeight: 405.51438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N5O3S/c1-3-10-21-19(28)23(11-7-12-27-2)15-16(20)24(18(26)22-17(15)25)13-14-8-5-4-6-9-14/h4-6,8-9H,3,7,10-13,20H2,1-2H3,(H,21,28)(H,22,25,26)