N-butylbutan-1-amine; 5-(3,4-dimethoxyphenyl)-6-ethyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-2-one

Systemtic Name: N-butylbutan-1-amine; 5-(3,4-dimethoxyphenyl)-6-ethyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-2-one Openeye Name: 3-benzyl-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one; N-butylbutan-1-amine CAS Name: N-butyl-1-butanamine; 5-(3,4-dimethoxyphenyl)-6-ethyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-2-one IUPAC Name: 3-benzyl-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one; N-butylbutan-1-amine Traditional Name: 3-benzyl-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one; dibutylamine Formula: C28H41N3O3S MolecularWeight: 499.70844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCC.CCC1C(=NN(C(=O)S1)CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCNCCCC.CCC1C(=NN(C(=O)S1)CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H22N2O3S.C8H19N/c1-4-18-19(15-10-11-16(24-2)17(12-15)25-3)21-22(20(23)26-18)13-14-8-6-5-7-9-14;1-3-5-7-9-8-6-4-2/h5-12,18H,4,13H2,1-3H3;9H,3-8H2,1-2H3