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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NC2=CC=C(C=C2)CC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=S)NC2=CC=C(C=C2)CC)N

InChI

InChI=1S/C20H29N5O3S/c1-4-6-11-25-17(21)16(18(26)23-19(25)27)24(12-13-28-3)20(29)22-15-9-7-14(5-2)8-10-15/h7-10H,4-6,11-13,21H2,1-3H3,(H,22,29)(H,23,26,27)