[2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-butyl-amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-butyl-amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-butyl-amino]-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-butylamino]-2-oxoethyl] ester IUPAC Name: [2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-butylamino]-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-butyl-amino]-2-keto-ethyl] ester Formula: C19H33N5O3S2 MolecularWeight: 443.62702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CSC(=S)N(CC)CC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CSC(=S)N(CC)CC)N

InChI

InChI=1S/C19H33N5O3S2/c1-5-9-11-23(14(25)13-29-19(28)22(7-3)8-4)15-16(20)24(12-10-6-2)18(27)21-17(15)26/h5-13,20H2,1-4H3,(H,21,26,27)