N-[4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-methyl-amino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-methylamino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-methylamino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-methyl-amino]-4-keto-butyl]thiophene-3-carboxamide Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CCCNC(=O)C2=CSC=C2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CCCNC(=O)C2=CSC=C2)N

InChI

InChI=1S/C18H25N5O4S/c1-3-4-9-23-15(19)14(17(26)21-18(23)27)22(2)13(24)6-5-8-20-16(25)12-7-10-28-11-12/h7,10-11H,3-6,8-9,19H2,1-2H3,(H,20,25)(H,21,26,27)