3-azanyl-6-methyl-2-(2H-1,2,3,4-tetrazol-5-yl)-8-[2-(4-thiophen-2-ylbutoxy)phenyl]carbonyl-chromen-4-one

Systemtic Name: 3-azanyl-6-methyl-2-(2H-1,2,3,4-tetrazol-5-yl)-8-[2-(4-thiophen-2-ylbutoxy)phenyl]carbonyl-chromen-4-one Openeye Name: 3-amino-6-methyl-2-(2H-tetrazol-5-yl)-8-[2-[4-(2-thienyl)butoxy]benzoyl]chromen-4-one CAS Name: 3-amino-6-methyl-8-[oxo-[2-(4-thiophen-2-ylbutoxy)phenyl]methyl]-2-(2H-tetrazol-5-yl)-1-benzopyran-4-one IUPAC Name: 3-amino-6-methyl-2-(2H-tetrazol-5-yl)-8-[2-(4-thiophen-2-ylbutoxy)benzoyl]chromen-4-one Traditional Name: 3-amino-6-methyl-2-(2H-tetrazol-5-yl)-8-[2-[4-(2-thienyl)butoxy]benzoyl]chromone Formula: C26H23N5O4S MolecularWeight: 501.55692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=NNN=N3)N)C(=O)C4=CC=CC=C4OCCCCC5=CC=CS5

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=NNN=N3)N)C(=O)C4=CC=CC=C4OCCCCC5=CC=CS5

InChI

InChI=1S/C26H23N5O4S/c1-15-13-18(24-19(14-15)23(33)21(27)25(35-24)26-28-30-31-29-26)22(32)17-9-2-3-10-20(17)34-11-5-4-7-16-8-6-12-36-16/h2-3,6,8-10,12-14H,4-5,7,11,27H2,1H3,(H,28,29,30,31)