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

Systemtic Name: 1-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(2-methoxyethyl)-3-phenethyl-thiourea Openeye Name: 1-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-1-(2-methoxyethyl)-3-phenethyl-thiourea CAS Name: 1-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-1-(2-methoxyethyl)-3-phenethylthiourea IUPAC Name: 1-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-1-(2-methoxyethyl)-3-phenethylthiourea Traditional Name: 1-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-1-(2-methoxyethyl)-3-phenethyl-thiourea Formula: C20H29N5O3S MolecularWeight: 419.54096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NCCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NCCC2=CC=CC=C2)N

InChI

InChI=1S/C20H29N5O3S/c1-14(2)13-25-17(21)16(18(26)23-19(25)27)24(11-12-28-3)20(29)22-10-9-15-7-5-4-6-8-15/h4-8,14H,9-13,21H2,1-3H3,(H,22,29)(H,23,26,27)