N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(1,3-benzothiazol-2-yl)-N-butyl-butanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(1,3-benzothiazol-2-yl)-N-butyl-butanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-(1,3-benzothiazol-2-yl)-N-butyl-butanamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-(1,3-benzothiazol-2-yl)-N-butylbutanamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-(1,3-benzothiazol-2-yl)-N-butylbutanamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-4-(1,3-benzothiazol-2-yl)-N-butyl-butyramide Formula: C23H31N5O3S MolecularWeight: 457.58894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CCCC2=NC3=CC=CC=C3S2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)CCCC2=NC3=CC=CC=C3S2)N

InChI

InChI=1S/C23H31N5O3S/c1-3-5-14-27(20-21(24)28(15-6-4-2)23(31)26-22(20)30)19(29)13-9-12-18-25-16-10-7-8-11-17(16)32-18/h7-8,10-11H,3-6,9,12-15,24H2,1-2H3,(H,26,30,31)