2-[1-[(3-chlorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]-3,3-dimethyl-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptan-7-one

Systemtic Name: 2-[1-[(3-chlorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]-3,3-dimethyl-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptan-7-one Openeye Name: 2-[1-[(3-chlorophenyl)methyl]tetrazol-5-yl]-3,3-dimethyl-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptan-7-one CAS Name: 2-[1-[(3-chlorophenyl)methyl]-5-tetrazolyl]-3,3-dimethyl-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptan-7-one IUPAC Name: 2-[1-[(3-chlorophenyl)methyl]tetrazol-5-yl]-3,3-dimethyl-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptan-7-one Traditional Name: 2-[1-(3-chlorobenzyl)tetrazol-5-yl]-3,3-dimethyl-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptan-7-one Formula: C34H31ClN6OS MolecularWeight: 607.16754

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=NN=NN6CC7=CC(=CC=C7)Cl)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=NN=NN6CC7=CC(=CC=C7)Cl)C

InChI

InChI=1S/C34H31ClN6OS/c1-33(2)29(30-37-38-39-40(30)22-23-13-12-20-27(35)21-23)41-31(42)28(32(41)43-33)36-34(24-14-6-3-7-15-24,25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,28-29,32,36H,22H2,1-2H3