5-(4-butyl-7-phenylmethoxy-chromen-2-ylidene)-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(4-butyl-7-phenylmethoxy-chromen-2-ylidene)-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(7-benzyloxy-4-butyl-chromen-2-ylidene)-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(4-butyl-7-phenylmethoxy-1-benzopyran-2-ylidene)-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(4-butyl-7-phenylmethoxychromen-2-ylidene)-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(7-benzoxy-4-butyl-chromen-2-ylidene)-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C(=O)N(C(=S)N(C2=O)CC)CC)OC3=C1C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC(=C2C(=O)N(C(=S)N(C2=O)CC)CC)OC3=C1C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H30N2O4S/c1-4-7-13-20-16-24(25-26(31)29(5-2)28(35)30(6-3)27(25)32)34-23-17-21(14-15-22(20)23)33-18-19-11-9-8-10-12-19/h8-12,14-17H,4-7,13,18H2,1-3H3