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

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-1-(2-methoxyethyl)-3-(phenylmethyl)thiourea Openeye Name: 1-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-3-benzyl-1-(2-methoxyethyl)thiourea CAS Name: 1-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-1-(2-methoxyethyl)-3-(phenylmethyl)thiourea IUPAC Name: 1-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-3-benzyl-1-(2-methoxyethyl)thiourea Traditional Name: 1-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-3-benzyl-1-(2-methoxyethyl)thiourea Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NCC2=CC=CC=C2)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NCC2=CC=CC=C2)N

InChI

InChI=1S/C18H25N5O3S/c1-3-9-23-15(19)14(16(24)21-17(23)25)22(10-11-26-2)18(27)20-12-13-7-5-4-6-8-13/h4-8H,3,9-12,19H2,1-2H3,(H,20,27)(H,21,24,25)