4-[(E)-3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[(E)-3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide Openeye Name: 4-[(E)-3-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]-3-oxo-prop-1-enyl]-N-cyclopropyl-benzamide CAS Name: 4-[(E)-3-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-ethylamino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide IUPAC Name: 4-[(E)-3-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide Traditional Name: 4-[(E)-3-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]-3-keto-prop-1-enyl]-N-cyclopropyl-benzamide Formula: C23H29N5O4 MolecularWeight: 439.50746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)C=CC2=CC=C(C=C2)C(=O)NC3CC3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)/C=C/C2=CC=C(C=C2)C(=O)NC3CC3)N

InChI

InChI=1S/C23H29N5O4/c1-3-5-14-28-20(24)19(22(31)26-23(28)32)27(4-2)18(29)13-8-15-6-9-16(10-7-15)21(30)25-17-11-12-17/h6-10,13,17H,3-5,11-12,14,24H2,1-2H3,(H,25,30)(H,26,31,32)/b13-8+