diethylazanide; (6Z)-6-(phenylazanylmethylidene)-2-thiophen-2-yl-cyclohexa-2,4-dien-1-one; titanium(2+)

Systemtic Name: diethylazanide; (6Z)-6-(phenylazanylmethylidene)-2-thiophen-2-yl-cyclohexa-2,4-dien-1-one; titanium(2+) Openeye Name: (6Z)-6-(anilinomethylene)-2-(2-thienyl)cyclohexa-2,4-dien-1-one; diethylazanide; titanium(2+) CAS Name: (6Z)-6-(anilinomethylidene)-2-thiophen-2-yl-1-cyclohexa-2,4-dienone; diethylazanide; titanium(2+) IUPAC Name: (6Z)-6-(anilinomethylidene)-2-thiophen-2-ylcyclohexa-2,4-dien-1-one; diethylazanide; titanium(2+) Traditional Name: (6Z)-6-(anilinomethylene)-2-(2-thienyl)cyclohexa-2,4-dien-1-one; diethylazanide; titanium(2+) Formula: C25H33N3OSTi MolecularWeight: 471.48102

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Descriptors Computed from Structure

Canonical SMILES:

CC[N-]CC.CC[N-]CC.C1=CC=C(C=C1)NC=C2C=CC=C(C2=O)C3=CC=CS3.[Ti+2]

Isomeric SMILES

CC[N-]CC.CC[N-]CC.C1=CC=C(C=C1)N/C=C\2/C=CC=C(C2=O)C3=CC=CS3.[Ti+2]

InChI

InChI=1S/C17H13NOS.2C4H10N.Ti/c19-17-13(12-18-14-7-2-1-3-8-14)6-4-9-15(17)16-10-5-11-20-16;2*1-3-5-4-2;/h1-12,18H;2*3-4H2,1-2H3;/q;2*-1;+2/b13-12-;;;