18-(benzotriazol-1-ylcarbonyl)-3-phenyldiazenyl-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one

Systemtic Name: 18-(benzotriazol-1-ylcarbonyl)-3-phenyldiazenyl-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one Openeye Name: 18-(benzotriazole-1-carbonyl)-3-phenylazo-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one CAS Name: 18-[1-benzotriazolyl(oxo)methyl]-3-phenyldiazenyl-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one IUPAC Name: 18-(benzotriazole-1-carbonyl)-3-phenyldiazenyl-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one Traditional Name: 18-(benzotriazole-1-carbonyl)-3-phenylazo-11-oxa-8-thia-18-azaspiro[5.12]octadeca-2,4-dien-12-one Formula: C28H30N6O3S MolecularWeight: 530.6412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)OCCSCC2(CC=C(C=C2)N=NC3=CC=CC=C3)N(CC1)C(=O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC(=O)OCCSCC2(CC=C(C=C2)N=NC3=CC=CC=C3)N(CC1)C(=O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C28H30N6O3S/c35-26-13-5-2-8-18-33(27(36)34-25-12-7-6-11-24(25)31-32-34)28(21-38-20-19-37-26)16-14-23(15-17-28)30-29-22-9-3-1-4-10-22/h1,3-4,6-7,9-12,14-16H,2,5,8,13,17-21H2